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(R)-2-benzylsuccinate

MNXM2471 is deprecated and here replaced by MNXM732986
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM732986 Image of MNXM732986
referencechebi:58692
formulaC11H10O4
global charge-2
mol weight206.197
InChIKeyGTOFKXZQQDSVFH-SECBINFHSA-L
InChIInChI=1S/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)/p-2/t9-/m1/s1
SMILESO=C([O-])C[C@@H](CC1=CC=CC=C1)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C11H12O4/c12-10(13)7-9(11(14)15)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H,12,13)(H,14,15)/t9-/m1/s1 Image of MNXM732986
SMILES (mnx)[CH:1]1=[CH:2][CH:4]=[C:8]([CH2:6][C@H:9]([CH2:7][C:10](=[O:12])[OH:13])[C:11](=[O:14])[OH:15])[CH:5]=[CH:3]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:58692
chebi:58692
GTOFKXZQQDSVFH-SECBINFHSA-L 		(R)-2-benzylsuccinate
(2R)-2-benzylbutanedioate

metacyc.compound:BENZYLSUCCINATE
metacycM:BENZYLSUCCINATE
GTOFKXZQQDSVFH-SECBINFHSA-L 		(R)-2-benzylsuccinate
(R)-2-benzylsuccinic acid

CHEBI:41241
chebi:41241
GTOFKXZQQDSVFH-SECBINFHSA-N 		(R)-2-benzylsuccinic acid
(2R)-2-benzylbutanedioic acid
(2R)-2-benzylsuccinic acid
(R)-2-Benzylsuccinate
L-BENZYLSUCCINIC ACID

CHEBI:57621
chebi:57621
GTOFKXZQQDSVFH-UHFFFAOYSA-L 		2-benzylsuccinate
2-benzylbutanedioate
2-benzylsuccinate dianion
2-benzylsuccinate(2-)

CHEBI:16054
chebi:16054
GTOFKXZQQDSVFH-UHFFFAOYSA-N 		2-benzylsuccinic acid
(phenylmethyl)butanedioic acid
2-benzylbutanedioic acid
Benzylsuccinate
D,L-Benzylsuccinic Acid
alpha-benzylsuccinic acid
benzylsuccinic acid
beta-carboxybenzenebutanoic acid

envipath:...70ca82f8461d
envipathM:...70ca82f8461d
GTOFKXZQQDSVFH-UHFFFAOYSA-L 		Benzylsuccinate

kegg.compound:C09816
keggC:C09816
GTOFKXZQQDSVFH-SECBINFHSA-N 		Benzylsuccinate
(R)-2-Benzylsuccinate

seed.compound:cpd06708
seedM:cpd06708
GTOFKXZQQDSVFH-SECBINFHSA-L 		Benzylsuccinate
(R)-2-Benzylsuccinate
(R)-2-benzylsuccinate
(R)-2-benzylsuccinic acid

envipath:...347cbdee240c
envipathM:...347cbdee240c
GTOFKXZQQDSVFH-UHFFFAOYSA-L 		compound 0044816

chebi:10969
chebi:13891
chebi:22751
chebi:28962
chebi:3059
chebi:41240
keggC:M_C09816
seedM:M_cpd06708 		secondary/obsolete/fantasy identifier